AB01333816-02
TL;DR: AB01333816-02 (CAS 489423-53-2) is a chemical compound with molecular formula C18H14F3N3OS and molecular weight 377.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-difluorophenyl)-4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: AB01333816-02, N-(3,4-difluorophenyl)-4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide, N-(3,4-difluorophenyl)-4-(2-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, N-(3,4-difluorophenyl)-6-(2-fluorophenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxamide
| Molecular Formula | C18H14F3N3OS |
|---|---|
| Molecular Weight | 377.08 g/mol |
| LogP | 3.5354 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.08096 |
| Heavy Atoms | 26 |
| Complexity | 929.6474 |
Chemical Identifiers
| CAS Number | 489423-53-2 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=CC=C2F)C(=O)NC3=CC(=C(C=C3)F)F |
Product Overview
AB01333816-02 (CAS 489423-53-2), with molecular formula C18H14F3N3OS and molecular weight 377.08 g/mol. IUPAC: N-(3,4-difluorophenyl)-4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB01333816-02
Property Insights of AB01333816-02
The XLogP value of 3.5354 indicates that AB01333816-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, AB01333816-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB01333816-02 has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB01333816-02?
The CAS number of AB01333816-02 is 489423-53-2.
What is the molecular formula of AB01333816-02?
The molecular formula of AB01333816-02 is C18H14F3N3OS.
What is the molecular weight of AB01333816-02?
The molecular weight of AB01333816-02 is 377.08 g/mol.
Where can I buy AB01333816-02?
You can request a quote for AB01333816-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01333816-02?
Yes, KEHONG BIO provides custom synthesis services for AB01333816-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.